4-Cyclopropylbenzoic acid
TL;DR: 4-Cyclopropylbenzoic acid (CAS 18060-84-9) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyclopropylbenzoic acid
Also Known As: 4-cyclopropylbenzoic acid, 4-Cyclopropyl-benzoic acid, benzoic acid, 4-cyclopropyl-, 4-CyclopropylbenzoicAcid, p-cyclopropylbenzoic acid
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.06808 |
| Heavy Atoms | 12 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 18060-84-9 |
|---|---|
| SMILES | C1CC1C2=CC=C(C=C2)C(=O)O |
| InChIKey | GJCRWEAWEDESNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Cyclopropylbenzoic acid (CAS 18060-84-9), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: 4-cyclopropylbenzoic acid.
Chemical Property Profile of 4-Cyclopropylbenzoic acid
Property Insights of 4-Cyclopropylbenzoic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Cyclopropylbenzoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 4-Cyclopropylbenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Cyclopropylbenzoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Cyclopropylbenzoic acid?
The CAS number of 4-Cyclopropylbenzoic acid is 18060-84-9.
What is the molecular formula of 4-Cyclopropylbenzoic acid?
The molecular formula of 4-Cyclopropylbenzoic acid is C10H10O2.
What is the molecular weight of 4-Cyclopropylbenzoic acid?
The molecular weight of 4-Cyclopropylbenzoic acid is 162.07 g/mol.
Where can I buy 4-Cyclopropylbenzoic acid?
You can request a quote for 4-Cyclopropylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cyclopropylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyclopropylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.